3-[2-oxidanylidene-3-[1-(phenylcarbonyl)piperidin-4-yl]-1,3-diazepan-1-yl]benzenecarboximidamide

Systemtic Name: 3-[2-oxidanylidene-3-[1-(phenylcarbonyl)piperidin-4-yl]-1,3-diazepan-1-yl]benzenecarboximidamide Openeye Name: 3-[3-(1-benzoyl-4-piperidyl)-2-oxo-1,3-diazepan-1-yl]benzamidine CAS Name: 3-[3-(1-benzoyl-4-piperidinyl)-2-oxo-1,3-diazepan-1-yl]benzenecarboximidamide IUPAC Name: 3-[3-(1-benzoylpiperidin-4-yl)-2-oxo-1,3-diazepan-1-yl]benzenecarboximidamide Traditional Name: 3-[3-(1-benzoyl-4-piperidyl)-2-keto-1,3-diazepan-1-yl]benzamidine Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)N(C1)C2CCN(CC2)C(=O)C3=CC=CC=C3)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CCN(C(=O)N(C1)C2CCN(CC2)C(=O)C3=CC=CC=C3)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C24H29N5O2/c25-22(26)19-9-6-10-21(17-19)29-14-5-4-13-28(24(29)31)20-11-15-27(16-12-20)23(30)18-7-2-1-3-8-18/h1-3,6-10,17,20H,4-5,11-16H2,(H3,25,26)